In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 21st, 2010 | 19 | Yes |
Popular Name: (1R)-1-(4-fluorophenyl)-N-methyl-N-[[(2S)-tetrahydropyran-2-yl]methyl]ethane-1,2-diamine (1R)-1-(4-fluorophenyl)-N-methyl…
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 1.77 | 4.55 | -53.12 | 3 | 3 | 1 | 40 | 267.368 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.77 | 6.59 | -123.16 | 4 | 3 | 2 | 41 | 268.376 | 5 | ↓ |